Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 313.4 BDBM50051365

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Lanosterol synthase (Rattus norvegicus)	BDBM50051365 ((6S,8aS)-5,5,8a-Trimethyl-2-(3-phenyl-propyl)-1,2,...) Show SMILES CC1(C)[C@@H](O)CC[C@]2(C)CN(CCCc3ccccc3)CC=C12 |t:22| Show InChI InChI=1S/C21H31NO/c1-20(2)18-12-15-22(16-21(18,3)13-11-19(20)23)14-7-10-17-8-5-4-6-9-17/h4-6,8-9,12,19,23H,7,10-11,13-16H2,1-3H3/t19-,21+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Laboratoires Fournier SCA Curated by ChEMBL					Assay Description Inhibitory activity against Oxidosqualene-lanosterol cyclase from Rat liver microsomes				J Med Chem 39: 2302-12 (1996) Article DOI: 10.1021/jm9504621 BindingDB Entry DOI: 10.7270/Q28G8JTB
					More data for this Ligand-Target Pair